(phenylmethyl) 4-[2-[(2-methyl-5-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-[(2-methyl-5-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylate Openeye Name: benzyl 4-[2-[(2-methyl-5-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl]-4-phenyl-piperidine-1-carboxylate CAS Name: 4-[2-[(2-methyl-5-phenyl-3-pyrazolyl)amino]-2-oxoethyl]-4-phenyl-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-[(2-methyl-5-phenylpyrazol-3-yl)amino]-2-oxoethyl]-4-phenylpiperidine-1-carboxylate Traditional Name: 4-[2-keto-2-[(2-methyl-5-phenyl-pyrazol-3-yl)amino]ethyl]-4-phenyl-piperidine-1-carboxylic acid benzyl ester Formula: C31H32N4O3 MolecularWeight: 508.61078

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C2=CC=CC=C2)NC(=O)CC3(CCN(CC3)C(=O)OCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=CC(=N1)C2=CC=CC=C2)NC(=O)CC3(CCN(CC3)C(=O)OCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H32N4O3/c1-34-28(21-27(33-34)25-13-7-3-8-14-25)32-29(36)22-31(26-15-9-4-10-16-26)17-19-35(20-18-31)30(37)38-23-24-11-5-2-6-12-24/h2-16,21H,17-20,22-23H2,1H3,(H,32,36)